Vitas-M small molecule compound
tetraethyl 5',5',8'-trimethyl-6'-(2-oxo-2-phenylethyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Catalog ID
STK789770
SMILES CCOC(=O)C1=C(C(=O)OCC)C2(C3=C(S1)C(C)(C)N(c1c3ccc(c1)C)CC(=O)c1ccccc1)SC(=C(S2)C(=O)OCC)C(=O)OCC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C37H39NO9S3 MW 737.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H39NO9S3/c1-8-44-32(40)27-28(33(41)45-9-2)48-31-26(37(27)49-29(34(42)46-10-3)30(50-37)35(43)47-11-4)23-18-17-21(5)19-24(23)38(36(31,6)7)20-25(39)22-15-13-12-14-16-22/h12-19H,8-11,20H2,1-7H3InChIKey
OIZPQRNUHHONOB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C(C13SC(=C(S3)C(=O)OCC)C(=O)OCC)C4=C(C=C(C=C4)C)N(C2(C)C)CC(=O)C5=CC=CC=C5)C(=O)OCC
InChI=1SC37H39NO9S3c184432(40)2728(33(41)4592)483126(37(27)4929(34(42)46103)30(5037)35(43)47114)23181721(5)1924(23)38(36(316)7)2025(39)22151312141622h1219H81120H217H3
MFCD01955821
tetraethyl558trimethyl6(2oxo2phenylethyl)56dihydrospiro((13)dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl558trimethyl6(2oxo2phenylethyl)56dihydrospiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
tetraethyl558trimethyl6phenacylspiro(13dithiole21thiopyrano(23c)quinoline)2345tetracarboxylate
ZINC000150358977
ZINC150358977
Check stock
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